20
eq HF/6-31G*
H       -0.378500      0.420400      2.147200
C        0.132700      0.043100      1.267400
C        0.790000     -2.048800      0.000000
C        0.132700      0.043100     -1.267400
C        0.132700     -1.487800     -1.263900
C       -0.537100      0.604200      0.000000
C        0.132700     -1.487800      1.263900
H        1.847500     -1.789700      0.000000
H        1.154800      0.410900     -1.315600
H       -0.892900     -1.848200     -1.326700
H       -0.892900     -1.848200      1.326700
H        1.154800      0.410900      1.315600
H        0.735400     -3.133800      0.000000
H       -0.378500      0.420400     -2.147200
H        0.644700     -1.856000     -2.148400
H        0.644700     -1.856000      2.148400
H       -1.577600      0.284600      0.000000
C       -0.530400      2.078400      0.000000
H       -0.500500      4.322700      0.000000
C       -0.513400      3.266000      0.000000

20
ax HF/6-31G*
H       -0.081400     -0.938200      2.149400
C       -0.583100     -0.557700      1.265700
C       -1.239600      1.532900      0.000000
C       -0.583100     -0.557700     -1.265700
C       -0.583100      0.973100     -1.265600
C        0.074900     -1.142300      0.000000
C       -0.583100      0.973100      1.265600
H       -2.297900      1.275300      0.000000
H       -1.609400     -0.917500     -1.303300
H        0.440100      1.333300     -1.333400
H        0.440100      1.333300      1.333400
H       -1.609400     -0.917500      1.303300
H       -1.184600      2.618000      0.000000
H       -0.081400     -0.938200     -2.149400
H       -1.101700      1.336700     -2.148400
H       -0.079400     -2.217700      0.000000
H       -1.101700      1.336700      2.148400
C        1.536300     -0.921200      0.000000
H        3.758200     -0.601000      0.000000
C        2.712100     -0.750800      0.000000

20
eq B3LYP/6-31G*
H       -0.377700      0.426800      2.162800
C        0.134900      0.042200      1.273400
C        0.793000     -2.057100      0.000000
C        0.134900      0.042200     -1.273400
C        0.134900     -1.493400     -1.268400
C       -0.538900      0.611700      0.000000
C        0.134900     -1.493400      1.268400
H        1.861200     -1.794400      0.000000
H        1.167400      0.415000     -1.318400
H       -0.902100     -1.855900     -1.330700
H       -0.902100     -1.855900      1.330700
H        1.167400      0.415000      1.318400
H        0.740800     -3.153300      0.000000
H       -0.377700      0.426800     -2.162800
H        0.648500     -1.867100     -2.163100
H        0.648500     -1.867100      2.163100
H       -1.587400      0.272500      0.000000
C       -0.537500      2.077100      0.000000
H       -0.507200      4.351200      0.000000
C       -0.519300      3.285100      0.000000

20
ax B3LYP/6-31G*
H        0.451500      2.165500      0.845300
C       -0.179700      1.270700      0.797100
C       -1.880000      0.000000     -0.597500
C       -0.179700     -1.270700      0.797100
C       -1.022000     -1.270500     -0.486600
C        0.703200     -0.000000      0.915100
C       -1.022000      1.270500     -0.486600
H       -2.631700      0.000000      0.206400
H       -0.844200     -1.297800      1.672300
H       -0.351800     -1.335900     -1.354300
H       -0.351800      1.335900     -1.354300
H       -0.844200      1.297800      1.672300
H       -2.435900      0.000000     -1.543700
H        0.451500     -2.165500      0.845200
H       -1.659100     -2.163600     -0.511700
H        1.170400     -0.000000      1.910300
H       -1.659100      2.163600     -0.511600
C        1.783600     -0.000000     -0.080300
H        3.457200      0.000000     -1.621000
C        2.671000      0.000000     -0.900900

20
eq B3LYP-D3/6-31G*
H       -0.497800      2.163200      0.273300
C       -0.013300      1.272200     -0.142600
C        2.173600     -0.000000     -0.352400
C       -0.013300     -1.272200     -0.142600
C        1.487700     -1.267000      0.180200
C       -0.708600      0.000000      0.402200
C        1.487700      1.267000      0.180200
H        2.126700     -0.000000     -1.451400
H       -0.159600     -1.309500     -1.230900
H        1.623000     -1.320300      1.270800
H        1.623000      1.320300      1.270800
H       -0.159600      1.309500     -1.230900
H        3.237100     -0.000000     -0.082300
H       -0.497800     -2.163200      0.273300
H        1.961500     -2.163800     -0.238200
H        1.961500      2.163800     -0.238200
H       -0.589800      0.000000      1.497700
C       -2.141100      0.000000      0.098400
H       -4.357900     -0.000000     -0.409500
C       -3.317900     -0.000000     -0.174300

20
ax B3LYP-D3/6-31G*
H        0.444300      2.165900      0.863500
C       -0.183900      1.269800      0.804000
C       -1.867300      0.000000     -0.606600
C       -0.183900     -1.269800      0.804000
C       -1.008400     -1.269400     -0.491200
C        0.699600     -0.000000      0.926100
C       -1.008400      1.269400     -0.491200
H       -2.620400      0.000000      0.196000
H       -0.861000     -1.289800      1.669600
H       -0.324500     -1.326100     -1.348700
H       -0.324500      1.326100     -1.348700
H       -0.861000      1.289800      1.669700
H       -2.419200      0.000000     -1.555000
H        0.444300     -2.165900      0.863500
H       -1.641900     -2.164400     -0.528800
H        1.167700     -0.000000      1.920700
H       -1.641900      2.164400     -0.528800
C        1.774500      0.000000     -0.073900
H        3.423700      0.000000     -1.640400
C        2.646900      0.000000     -0.910000

20
eq wB97x-D/6-31G*
H        0.496400     -2.157000      0.277600
C        0.013400     -1.267600     -0.140700
C       -2.166500      0.000000     -0.352900
C        0.013400      1.267600     -0.140700
C       -1.483400      1.263100      0.179000
C        0.702400     -0.000000      0.403100
C       -1.483400     -1.263100      0.179000
H       -2.118900      0.000000     -1.451000
H        0.161200      1.305400     -1.228200
H       -1.620700      1.317200      1.268400
H       -1.620700     -1.317200      1.268400
H        0.161200     -1.305400     -1.228200
H       -3.228500      0.000000     -0.082000
H        0.496400      2.157000      0.277600
H       -1.955500      2.158000     -0.242100
H       -1.955500     -2.158000     -0.242100
H        0.589100     -0.000000      1.497800
C        2.135600     -0.000000      0.097700
H        4.349600      0.000000     -0.411200
C        3.309600      0.000000     -0.175100

20
ax wB97x-D/6-31G*
H       -0.444100     -2.159500      0.864100
C        0.185200     -1.265400      0.804000
C        1.856500     -0.000000     -0.610300
C        0.185200      1.265400      0.803900
C        1.000800      1.265400     -0.491200
C       -0.691200      0.000000      0.929000
C        1.000900     -1.265400     -0.491200
H        2.613200      0.000000      0.187800
H        0.866100      1.287800      1.665700
H        0.314200      1.323400     -1.345800
H        0.314200     -1.323400     -1.345700
H        0.866100     -1.287800      1.665700
H        2.401200     -0.000000     -1.561400
H       -0.444200      2.159600      0.864000
H        1.634800      2.158500     -0.529600
H       -1.162200      0.000000      1.920500
H        1.634800     -2.158500     -0.529600
C       -1.765800     -0.000000     -0.072500
H       -3.411700     -0.000000     -1.639200
C       -2.635300     -0.000000     -0.907900

20
eq M06-2X/6-31G*
H       -0.499800      2.155100      0.271600
C       -0.013400      1.265300     -0.140700
C        2.161800      0.000000     -0.358500
C       -0.013400     -1.265300     -0.140700
C        1.482300     -1.261100      0.180300
C       -0.699000      0.000000      0.408000
C        1.482300      1.261100      0.180300
H        2.101000      0.000000     -1.455700
H       -0.160800     -1.293500     -1.228400
H        1.617400     -1.306300      1.270000
H        1.617400      1.306300      1.270000
H       -0.160800      1.293600     -1.228400
H        3.226000      0.000000     -0.099000
H       -0.499800     -2.155100      0.271600
H        1.955400     -2.157900     -0.234100
H        1.955400      2.157900     -0.234100
H       -0.582400     -0.000000      1.502200
C       -2.132800      0.000000      0.101000
H       -4.344500      0.000000     -0.418800
C       -3.305400     -0.000000     -0.177500

20
ax M06-2X/6-31G*
H        0.437300      2.157500      0.880900
C       -0.191100      1.264000      0.809800
C       -1.843900      0.000000     -0.618400
C       -0.191100     -1.264000      0.809800
C       -0.986600     -1.262800     -0.496700
C        0.684000     -0.000000      0.939400
C       -0.986600      1.262800     -0.496700
H       -2.600000      0.000000      0.179800
H       -0.884400     -1.281100      1.661300
H       -0.285400     -1.309700     -1.339900
H       -0.285400      1.309700     -1.339900
H       -0.884400      1.281100      1.661300
H       -2.387200      0.000000     -1.569600
H        0.437300     -2.157500      0.880900
H       -1.614800     -2.158500     -0.550800
H        1.157800     -0.000000      1.928900
H       -1.614800      2.158500     -0.550800
C        1.753800     -0.000000     -0.068900
H        3.388500      0.000000     -1.647900
C        2.617400      0.000000     -0.910600

20
eq wB97x-V/6-31G*
H       -0.288101      2.160279     -0.759311
C        0.128577      1.268145     -0.274089
C        0.346644     -0.000003      1.907931
C        0.128573     -1.268111     -0.274114
C       -0.191287     -1.264564      1.225799
C       -0.420912      0.000027     -0.960140
C       -0.191295      1.264567      1.225821
H        1.446780      0.000002      1.853349
H        1.218377     -1.301577     -0.423468
H       -1.283080     -1.314968      1.363764
H       -1.283089      1.314950      1.363775
H        1.218382      1.301600     -0.423430
H        0.081673     -0.000017      2.973957
H       -0.288121     -2.160227     -0.759360
H        0.228210     -2.162671      1.698950
H        0.228184      2.162667      1.699000
H       -1.517550      0.000025     -0.845299
C       -0.115176      0.000020     -2.400118
H        0.395139     -0.000065     -4.617799
C        0.158071     -0.000078     -3.575218

20
ax wB97x-V/6-31G*
H        0.862639      2.162455     -0.662504
C        0.800622      1.266598     -0.031343
C       -0.614108     -0.000001      1.642305
C        0.800620     -1.266585     -0.031364
C       -0.498900     -1.266510      0.782742
C        0.922812      0.000016     -0.908280
C       -0.498902      1.266517      0.782755
H        0.189445     -0.000005      2.396444
H        1.663018     -1.288400      0.652558
H       -1.354135     -1.319904      0.092878
H       -1.354135      1.319916      0.092889
H        1.663009      1.288385      0.652588
H       -1.564766     -0.000005      2.192807
H        0.862617     -2.162429     -0.662555
H       -0.541449     -2.163175      1.415880
H        1.911314      0.000017     -1.390452
H       -0.541455      2.163175      1.415905
C       -0.094099      0.000016     -1.977862
H       -1.677403     -0.000039     -3.613260
C       -0.936746     -0.000041     -2.842132

20
eq MP2/6-31G*
H       -0.372500      0.428700      2.153700
C        0.134800      0.040500      1.263100
C        0.802800     -2.039700      0.000000
C        0.134800      0.040500     -1.263100
C        0.134800     -1.488100     -1.259400
C       -0.542700      0.596900      0.000000
C        0.134800     -1.488100      1.259400
H        1.863600     -1.754200      0.000000
H        1.167100      0.413300     -1.296200
H       -0.901400     -1.850100     -1.308700
H       -0.901400     -1.850100      1.308700
H        1.167100      0.413300      1.296200
H        0.771200     -3.135900      0.000000
H       -0.372500      0.428700     -2.153700
H        0.640900     -1.863400     -2.156900
H        0.640900     -1.863400      2.156900
H       -1.587900      0.250300      0.000000
C       -0.543600      2.061000      0.000000
H       -0.508200      4.349000      0.000000
C       -0.523500      3.282500      0.000000

20
ax MP2/6-31G*
H        0.433100      2.155400      0.885700
C       -0.196300      1.261200      0.811000
C       -1.839200     -0.000000     -0.626600
C       -0.196200     -1.261200      0.811100
C       -0.986800     -1.263200     -0.496300
C        0.677700      0.000000      0.937000
C       -0.986900      1.263200     -0.496400
H       -2.605400     -0.000000      0.161300
H       -0.891400     -1.281600      1.661900
H       -0.287000     -1.322200     -1.339100
H       -0.287000      1.322100     -1.339200
H       -0.891400      1.281600      1.661800
H       -2.373600     -0.000100     -1.584300
H        0.433100     -2.155300      0.885800
H       -1.621000     -2.156500     -0.546800
H        1.152700      0.000100      1.928000
H       -1.621100      2.156400     -0.546900
C        1.741200      0.000000     -0.073900
H        3.414300     -0.000200     -1.635600
C        2.644000      0.000000     -0.897900

20
eq HF/6-311+G**
H       -0.381100      0.420200      2.146900
C        0.131900      0.043000      1.267600
C        0.787600     -2.049000      0.000000
C        0.131900      0.043000     -1.267600
C        0.131900     -1.487200     -1.263300
C       -0.535400      0.605200      0.000000
C        0.131900     -1.487200      1.263300
H        1.846500     -1.791800      0.000000
H        1.154700      0.411400     -1.317500
H       -0.894500     -1.847800     -1.327700
H       -0.894500     -1.847800      1.327700
H        1.154700      0.411400      1.317500
H        0.731000     -3.134500      0.000000
H       -0.381100      0.420200     -2.146900
H        0.644800     -1.854500     -2.148300
H        0.644800     -1.854500      2.148300
H       -1.578400      0.292600      0.000000
C       -0.526800      2.077700      0.000000
H       -0.499500      4.318800      0.000000
C       -0.510900      3.263800      0.000000

20
ax HF/6-311+G**
H       -0.079000     -0.929200      2.149400
C       -0.582100     -0.548800      1.266100
C       -1.237600      1.541800      0.000000
C       -0.582100     -0.548800     -1.266100
C       -0.582100      0.981500     -1.265000
C        0.071200     -1.137000      0.000000
C       -0.582100      0.981500      1.265000
H       -2.297400      1.286000      0.000000
H       -1.609200     -0.908300     -1.305000
H        0.441700      1.342400     -1.333200
H        0.441700      1.342400      1.333200
H       -1.609200     -0.908300      1.305000
H       -1.180400      2.627200      0.000000
H       -0.079000     -0.929200     -2.149400
H       -1.101000      1.344500     -2.148500
H       -0.089100     -2.211400      0.000000
H       -1.101000      1.344500      2.148500
C        1.533900     -0.934700      0.000000
H        3.758800     -0.663000      0.000000
C        2.711500     -0.791600      0.000000

20
eq B3LYP/6-311+G**
H       -0.379700      0.425400      2.159200
C        0.134400      0.042800      1.273100
C        0.790300     -2.056500      0.000000
C        0.134400      0.042800     -1.273100
C        0.134400     -1.491600     -1.267600
C       -0.536600      0.613100      0.000000
C        0.134400     -1.491600      1.267600
H        1.857200     -1.798300      0.000000
H        1.164400      0.415400     -1.320300
H       -0.899900     -1.854200     -1.332700
H       -0.899900     -1.854200      1.332700
H        1.164400      0.415400      1.320300
H        0.734300     -3.149800      0.000000
H       -0.379700      0.425400     -2.159200
H        0.648800     -1.863100     -2.159600
H        0.648800     -1.863100      2.159600
H       -1.585200      0.282700      0.000000
C       -0.536100      2.075200      0.000000
H       -0.504900      4.340900      0.000000
C       -0.516500      3.278600      0.000000

20
ax B3LYP/6-311+G**
H        0.459200      2.162100      0.824800
C       -0.173500      1.271100      0.787900
C       -1.892100     -0.000000     -0.581900
C       -0.173500     -1.271100      0.787900
C       -1.033400     -1.269600     -0.482700
C        0.707400      0.000000      0.901800
C       -1.033400      1.269600     -0.482700
H       -2.632600     -0.000000      0.229200
H       -0.825100     -1.303700      1.669700
H       -0.380000     -1.337400     -1.360200
H       -0.380000      1.337400     -1.360200
H       -0.825100      1.303700      1.669700
H       -2.458000     -0.000000     -1.519000
H        0.459200     -2.162100      0.824800
H       -1.670000     -2.160100     -0.496800
H        1.178500      0.000000      1.892000
H       -1.670000      2.160100     -0.496800
C        1.790400      0.000000     -0.086100
H        3.477300      0.000000     -1.599200
C        2.685900     -0.000000     -0.890400

20
eq B3LYP-D3/6-311+G**
H        0.496900     -2.159700      0.275000
C        0.014000     -1.271800     -0.142600
C       -2.172300     -0.000000     -0.350500
C        0.014000      1.271800     -0.142600
C       -1.485900      1.266200      0.179900
C        0.709300      0.000000      0.399800
C       -1.485900     -1.266200      0.179900
H       -2.129100     -0.000000     -1.447400
H        0.160700      1.310900     -1.228400
H       -1.621700      1.322000      1.267900
H       -1.621700     -1.322000      1.267900
H        0.160700     -1.310900     -1.228400
H       -3.232400     -0.000000     -0.077800
H        0.496900      2.159700      0.275000
H       -1.957700      2.160300     -0.239500
H       -1.957700     -2.160300     -0.239500
H        0.598300      0.000000      1.493500
C        2.138900      0.000000      0.098500
H        4.347400     -0.000000     -0.408000
C        3.311000     -0.000000     -0.174100

20
ax B3LYP-D3/6-311+G**
H        0.451300      2.162500      0.845400
C       -0.178200      1.270000      0.795800
C       -1.878500      0.000000     -0.592300
C       -0.178200     -1.270000      0.795800
C       -1.018800     -1.268400     -0.487600
C        0.703600     -0.000000      0.913600
C       -1.018800      1.268400     -0.487600
H       -2.621100     -0.000000      0.217000
H       -0.843600     -1.294600      1.667400
H       -0.350100     -1.327000     -1.354100
H       -0.350100      1.327100     -1.354100
H       -0.843600      1.294500      1.667500
H       -2.439500      0.000000     -1.532200
H        0.451300     -2.162600      0.845300
H       -1.651700     -2.161000     -0.515600
H        1.176200     -0.000000      1.902800
H       -1.651700      2.161000     -0.515500
C        1.780300      0.000000     -0.079700
H        3.441100      0.000000     -1.621100
C        2.660600      0.000000     -0.900100

20
eq wB97x-D/6-311+G**
H       -0.496100      2.153800      0.279900
C       -0.014100      1.266700     -0.139400
C        2.163700      0.000000     -0.352800
C       -0.014100     -1.266700     -0.139400
C        1.481400     -1.261800      0.178300
C       -0.702400     -0.000000      0.402400
C        1.481400      1.261800      0.178300
H        2.116800      0.000000     -1.449400
H       -0.163500     -1.305700     -1.225100
H        1.620000     -1.317200      1.265900
H        1.620000      1.317200      1.265900
H       -0.163500      1.305700     -1.225100
H        3.223900      0.000000     -0.082700
H       -0.496100     -2.153800      0.279900
H        1.951600     -2.155200     -0.242900
H        1.951600      2.155200     -0.242900
H       -0.596300     -0.000000      1.496000
C       -2.132500     -0.000000      0.097800
H       -4.338300      0.000000     -0.412800
C       -3.301600      0.000000     -0.176400

20
ax wB97x-D/6-311+G**
H       -0.450400     -2.156500      0.848700
C        0.180300     -1.265200      0.796700
C        1.865400      0.000000     -0.597500
C        0.180300      1.265200      0.796700
C        1.009200      1.263900     -0.488100
C       -0.694200     -0.000000      0.918400
C        1.009200     -1.263900     -0.488100
H        2.613000      0.000000      0.206900
H        0.851400      1.291400      1.663800
H        0.334800      1.322500     -1.350400
H        0.334800     -1.322500     -1.350400
H        0.851400     -1.291400      1.663800
H        2.419300      0.000000     -1.541000
H       -0.450400      2.156500      0.848700
H        1.642000      2.155800     -0.519500
H       -1.170000     -0.000000      1.905000
H        1.642000     -2.155800     -0.519500
C       -1.769600     -0.000000     -0.078000
H       -3.425800      0.000000     -1.622100
C       -2.646100      0.000000     -0.899000

20
eq M06-2X/6-311+G**
H       -0.499800      2.152200      0.275000
C       -0.014800      1.265400     -0.139400
C        2.159600     -0.000000     -0.359700
C       -0.014800     -1.265400     -0.139400
C        1.480800     -1.260800      0.179900
C       -0.699000      0.000000      0.409100
C        1.480800      1.260800      0.179900
H        2.098500     -0.000000     -1.454600
H       -0.164000     -1.294200     -1.224800
H        1.617800     -1.307200      1.267200
H        1.617800      1.307100      1.267200
H       -0.164000      1.294300     -1.224800
H        3.221500     -0.000000     -0.100400
H       -0.499800     -2.152200      0.275000
H        1.951400     -2.155300     -0.236100
H        1.951400      2.155300     -0.236000
H       -0.589400      0.000000      1.501700
C       -2.129900      0.000000      0.101900
H       -4.333100     -0.000000     -0.423200
C       -3.297600     -0.000000     -0.180100

20
ax M06-2X/6-311+G**
H        0.444500      2.154600      0.865800
C       -0.186000      1.264800      0.803700
C       -1.853700      0.000000     -0.605900
C       -0.186000     -1.264800      0.803700
C       -0.994800     -1.262300     -0.494200
C        0.687600     -0.000000      0.929800
C       -0.994800      1.262300     -0.494200
H       -2.600300      0.000000      0.198300
H       -0.869600     -1.285500      1.660200
H       -0.305800     -1.309400     -1.344800
H       -0.305800      1.309400     -1.344800
H       -0.869600      1.285500      1.660200
H       -2.404600      0.000000     -1.550000
H        0.444500     -2.154600      0.865800
H       -1.622300     -2.156000     -0.540400
H        1.166800     -0.000000      1.913900
H       -1.622300      2.156000     -0.540400
C        1.757400     -0.000000     -0.074800
H        3.401700      0.000000     -1.632700
C        2.627300      0.000000     -0.903400

20
eq wB97x-V/6-311+G**
H       -0.291438      2.157135     -0.758122
C        0.127117      1.267507     -0.273989
C        0.346830     -0.000000      1.905772
C        0.127115     -1.267507     -0.273989
C       -0.190616     -1.263300      1.224636
C       -0.419919      0.000001     -0.959458
C       -0.190614      1.263300      1.224636
H        1.445528     -0.000001      1.851496
H        1.215236     -1.303039     -0.424948
H       -1.280703     -1.315149      1.364474
H       -1.280702      1.315150      1.364473
H        1.215238      1.303038     -0.424947
H        0.082675     -0.000000      2.970152
H       -0.291441     -2.157134     -0.758123
H        0.229538     -2.159850      1.695856
H        0.229539      2.159850      1.695856
H       -1.515554      0.000002     -0.852537
C       -0.113982      0.000000     -2.396360
H        0.396500     -0.000001     -4.607235
C        0.159655     -0.000002     -3.567644

20
ax wB97x-V/6-311+G**
H        0.848835      2.159516     -0.666011
C        0.792863      1.266452     -0.033493
C       -0.608244     -0.000004      1.648743
C        0.792869     -1.266448     -0.033496
C       -0.499507     -1.265057      0.789103
C        0.914748      0.000003     -0.908017
C       -0.499511      1.265054      0.789109
H        0.198985     -0.000005      2.396958
H        1.658279     -1.291815      0.643988
H       -1.359892     -1.318802      0.107890
H       -1.359899      1.318803      0.107901
H        1.658275      1.291821      0.643987
H       -1.553597     -0.000006      2.204638
H        0.848848     -2.159509     -0.666016
H       -0.537228     -2.160503      1.421060
H        1.900214      0.000007     -1.391417
H       -0.537229      2.160495      1.421073
C       -0.093389      0.000001     -1.982088
H       -1.647034     -0.000002     -3.636229
C       -0.918383      0.000000     -2.857682

20
eq MP2/6-311+G**
H       -0.377300      0.429500      2.154000
C        0.132500      0.041100      1.265100
C        0.807400     -2.038200      0.000000
C        0.132500      0.041100     -1.265100
C        0.132500     -1.490100     -1.260600
C       -0.547000      0.597100      0.000000
C        0.132500     -1.490100      1.260600
H        1.865200     -1.740300      0.000000
H        1.165500      0.413700     -1.295500
H       -0.904800     -1.851300     -1.303100
H       -0.904800     -1.851300      1.303100
H        1.165500      0.413700      1.295500
H        0.782900     -3.134200      0.000000
H       -0.377300      0.429500     -2.154000
H        0.637600     -1.864400     -2.158600
H        0.637600     -1.864400      2.158600
H       -1.593500      0.255600      0.000000
C       -0.545900      2.060500      0.000000
H       -0.489100      4.346300      0.000000
C       -0.512500      3.281500      0.000000

20
ax MP2/6-311+G**
H       -0.434200     -2.157300      0.886900
C        0.195200     -1.263500      0.812100
C        1.842100      0.000100     -0.624700
C        0.195000      1.263400      0.812300
C        0.985900      1.264500     -0.498200
C       -0.680500     -0.000100      0.940000
C        0.986000     -1.264300     -0.498400
H        2.603400      0.000100      0.168500
H        0.893500      1.278700      1.660600
H        0.286500      1.317700     -1.342300
H        0.286700     -1.317600     -1.342500
H        0.893600     -1.278900      1.660400
H        2.377600      0.000200     -1.581300
H       -0.434400      2.157100      0.887200
H        1.618600      2.158400     -0.547800
H       -1.157300     -0.000200      1.928900
H        1.618900     -2.158200     -0.548000
C       -1.745400     -0.000100     -0.069100
H       -3.408400      0.000100     -1.639100
C       -2.635700      0.000000     -0.905900
